stefanbringuier
Materials Science & Engineering; Computational Materials Science; Integrated Computational Materials Engineering; Materials Informatics
Independent Researcher
Pinned Repositories
ADIP2.jl
Automatic Differentiation of Interatomic Potentials with Phonons in Julia: ADIP².jl
CBFV.jl
A simple composition-based feature vectorization utility in Julia
LearnHartreeFock.jl
Learning how to code a package for solving simple Hartree-Fock electronic structure calculations.
BestPractices
Things that you should (and should not) do in your Materials Informatics research.
Hermes.jl
An inline AI messenger for Pluto.jl notebooks
HowToSOVITO
A series of recipes and tutorials on how to use python scripting with OVITO
MDJulia
Code to calculate bond-angle distribution from molecular dynamics simulations
PlutoNotebookBlogging
Blogging using Pluto.jl notebooks.
QuantumComputingProblemsSolutions
Solving quantum computing problems in Julia using Sympy.jl within Pluto.jl notebooks
SMA_GNNIP
Calculations, analysis, & manuscript for "Suitability of Graph Neural Network for Shape Memory Alloys"
stefanbringuier's Repositories
stefanbringuier/Hermes.jl
An inline AI messenger for Pluto.jl notebooks
stefanbringuier/HowToSOVITO
A series of recipes and tutorials on how to use python scripting with OVITO
stefanbringuier/MDJulia
Code to calculate bond-angle distribution from molecular dynamics simulations
stefanbringuier/BestPractices
Things that you should (and should not) do in your Materials Informatics research.
stefanbringuier/CrashCourseSCMaterials
Notes for anyone who is interested in quickly familiarizing themselves with superconductors from a materials science perspective
stefanbringuier/coauthors
Generate a DataFrame or file of coauthors for proposals
stefanbringuier/PolyCrysGen
Generate Multiphase Polycrystalline LAMMPS data files using Atomsk and ASE
stefanbringuier/ASE.jl
Julia Bindings for Atomic Simulation Environment
stefanbringuier/AtomsIO.jl
Standard input/output package for AtomsBase-compatible structures
stefanbringuier/bibtex-biber-action
Check .bib file using biber
stefanbringuier/PlutoNotebookBlogging
Blogging using Pluto.jl notebooks.
stefanbringuier/awesome-materials-informatics
Curated list of known efforts in materials informatics
stefanbringuier/awesome-self-driving-labs
A curated list of self-driving laboratories that combine hardware automation and artificial intelligence to accelerate scientific discovery.
stefanbringuier/BLOOM-fine-tuning
Finetune BLOOM
stefanbringuier/DOI2BibTeX.jl
stefanbringuier/InteratomicPotentials.jl
Contains methods and types for a variety interatomic potentials.
stefanbringuier/JuliaPkgCitations
BibTeX file for popular Julia Packages
stefanbringuier/KMCNotes
Kinetic Monte Carlo Notes
stefanbringuier/LAMMPS.jl
stefanbringuier/matgl
Graph deep learning library for materials
stefanbringuier/PeriodicTable.jl
Periodic Table for Julians! :fire:
stefanbringuier/PlutoNotebookTemplates
Leverage featured notebook approach for my notebook templates
stefanbringuier/PlutoToPkg.jl
A simple utility to convert Pluto.jl notebooks to Julia project/package folder.
stefanbringuier/QuickFitSNAP
An attempt to fit ab-initio materials database (e.g. Materials Project) results to FitSNAP potential.
stefanbringuier/randomonium
My eclectic mix of code and notebooks for experimentation and exploration
stefanbringuier/RustVACF
Basic utility for velocity autocorrelation written in Rust.
stefanbringuier/ShortCodes.jl
Short codes to embed content in Pluto notebooks
stefanbringuier/tikz
Random collection of standalone TikZ images
stefanbringuier/TinyNN.jl
A simple, from scratch, dense neural network for classification in Julia.
stefanbringuier/youtube-transcripts
Pass in a YouTube URL and to generate a transcript of the audio